3-methyl-3-propan-2-yl-1,4-dihydroisothiochromene

Systemtic Name: 3-methyl-3-propan-2-yl-1,4-dihydroisothiochromene Openeye Name: 3-isopropyl-3-methyl-isothiochromane CAS Name: 3-methyl-3-propan-2-yl-1,4-dihydro-2-benzothiopyran IUPAC Name: 3-methyl-3-propan-2-yl-1,4-dihydroisothiochromene Traditional Name: 3-isopropyl-3-methyl-isothiochroman Formula: C13H18S MolecularWeight: 206.34702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CC2=CC=CC=C2CS1)C

Isomeric SMILES

CC(C)C1(CC2=CC=CC=C2CS1)C

InChI

InChI=1S/C13H18S/c1-10(2)13(3)8-11-6-4-5-7-12(11)9-14-13/h4-7,10H,8-9H2,1-3H3